1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C18H25N5O4S2 MolecularWeight: 439.5522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H25N5O4S2/c1-11(2)19-17(24)12(3)20-18(25)13-7-9-23(10-8-13)29(26,27)15-6-4-5-14-16(15)22-28-21-14/h4-6,11-13H,7-10H2,1-3H3,(H,19,24)(H,20,25)/t12-/m0/s1